%chk=000186269.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186269

0 1
O -1.789976 -1.242933 0.233013
O 1.517544 -1.161426 0.475123
O -1.900001 -2.512997 -1.631721
O 1.978256 0.033455 -1.398246
C -0.294973 1.972109 -0.864647
C -1.356507 0.875067 -0.787337
C 0.370705 2.065956 0.488916
C -0.699864 -0.443317 -0.346288
C 0.325702 -0.391149 0.820092
C 0.713162 0.985210 1.281705
C -0.728974 3.406386 -1.094202
C 0.500833 3.412558 0.925209
C -0.186321 4.253833 -0.068639
C 1.344272 1.255936 2.512460
C 1.119495 3.669866 2.139829
C -1.472685 3.942730 -2.128015
C -0.390563 5.623408 -0.107551
C 1.558468 2.575688 2.914063
C -1.683237 5.336169 -2.153489
C -1.148362 6.160486 -1.166093
C -2.320482 -2.270568 -0.523566
C 2.303230 -0.824686 -0.609498
C -3.403647 -2.953624 0.221218
C 3.514452 -1.679114 -0.640894
C -3.989192 -4.090263 -0.360726
C -3.844948 -2.488830 1.469043
C 4.436358 -1.474994 -1.681221
C 3.747348 -2.665347 0.329083
C -5.014364 -4.759465 0.310489
C -4.871633 -3.163530 2.133889
C 5.589777 -2.258964 -1.745990
C 4.903417 -3.446235 0.256821
C -5.454654 -4.296597 1.555809
C 5.822551 -3.243127 -0.778420
H 0.475382 1.692498 -1.641614
H -2.158066 1.154928 -0.072483
H -1.857807 0.735756 -1.764135
H -0.268303 -0.989701 -1.220552
H -0.050416 -1.017917 1.673095
H 1.661562 0.431615 3.148911
H 1.256161 4.686759 2.498849
H -1.887879 3.311140 -2.909560
H 0.021044 6.273971 0.659784
H 2.060470 2.770689 3.860968
H -2.271138 5.768499 -2.961758
H -1.316078 7.235390 -1.206978
H -3.637210 -4.440209 -1.335229
H -3.382499 -1.602165 1.910517
H 4.241652 -0.703542 -2.431563
H 3.021832 -2.815919 1.132620
H -5.471158 -5.641402 -0.136689
H -5.218025 -2.806014 3.102570
H 6.307182 -2.104165 -2.550776
H 5.087739 -4.213879 1.006895
H -6.255771 -4.820993 2.077283
H 6.723739 -3.854329 -0.832174


%chk=000186269-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186269

0 1
O -1.717040 -1.244800 0.439705
O 1.449499 -1.087693 0.800953
O -2.163206 -1.908293 -1.753948
O 2.076281 0.034372 -1.151409
C -0.468996 2.163702 -0.760814
C -1.518663 1.074125 -0.429865
C 0.413918 2.344483 0.449578
C -0.749748 -0.225503 -0.079250
C 0.328109 -0.097866 1.035351
C 0.843887 1.309497 1.285075
C -0.885609 3.601172 -1.065660
C 0.640303 3.714703 0.740292
C -0.163640 4.506335 -0.218168
C 1.639941 1.655167 2.408421
C 1.447359 4.057681 1.847802
C -1.761347 4.091282 -2.048557
C -0.324315 5.901384 -0.362469
C 1.960370 3.012488 2.659612
C -1.929530 5.493500 -2.182811
C -1.213665 6.388603 -1.349693
C -2.364485 -2.035139 -0.520094
C 2.267803 -0.886403 -0.317203
C -3.295144 -3.020733 0.101859
C 3.366343 -1.892699 -0.391824
C -3.994276 -3.907671 -0.757967
C -3.494525 -3.090735 1.505341
C 4.284448 -1.794457 -1.470109
C 3.508294 -2.929271 0.567498
C -4.883676 -4.858796 -0.218386
C -4.387032 -4.043399 2.040433
C 5.337244 -2.724312 -1.586826
C 4.562868 -3.858333 0.444988
C -5.081828 -4.928376 1.181665
C 5.478237 -3.758052 -0.629896
H 0.153266 1.787900 -1.602313
H -2.140806 1.394466 0.426670
H -2.183295 0.863213 -1.286063
H -0.301940 -0.626623 -1.004193
H -0.096797 -0.507812 1.967937
H 2.002710 0.873744 3.086435
H 1.656675 5.102617 2.102342
H -2.309799 3.405862 -2.704794
H 0.225231 6.600393 0.278104
H 2.586122 3.261597 3.523980
H -2.616679 5.889565 -2.938941
H -1.352313 7.468787 -1.471840
H -3.824214 -3.833891 -1.837193
H -2.951200 -2.401769 2.157630
H 4.153316 -0.987670 -2.198783
H 2.793437 -2.996957 1.392021
H -5.421210 -5.543323 -0.883243
H -4.541884 -4.097607 3.123466
H 6.044906 -2.646908 -2.419182
H 4.671869 -4.659842 1.183613
H -5.773991 -5.667311 1.600899
H 6.296016 -4.481695 -0.721973


